1-adamantyl-(3-azanyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl)methanone

Systemtic Name: 1-adamantyl-(3-azanyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl)methanone Openeye Name: 1-adamantyl-[3-amino-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl]methanone CAS Name: 1-adamantyl-(3-amino-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl)methanone IUPAC Name: 1-adamantyl-(3-amino-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl)methanone Traditional Name: 1-adamantyl-[3-amino-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl]methanone Formula: C26H28N2OS2 MolecularWeight: 448.64332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)C45CC6CC(C4)CC(C6)C5)N)C7=CC=CS7

Isomeric SMILES

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)C45CC6CC(C4)CC(C6)C5)N)C7=CC=CS7

InChI

InChI=1S/C26H28N2OS2/c27-22-21-20(19-6-3-7-30-19)17-4-1-2-5-18(17)28-25(21)31-23(22)24(29)26-11-14-8-15(12-26)10-16(9-14)13-26/h3,6-7,14-16H,1-2,4-5,8-13,27H2